SCHEMBL9601020

SCHEMBL9601020

CC(=O)Nc1ccn([C@@H]2O[C@H](COC(C)=O)[C@@H](O)[C@H]2O)c(=O)n1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 9/20 0.55
P2RY14 Q15391 2/20 0.55
NT5E P21589 1/20 0.55
P2RY2 P41231 7/20 0.54
P2RY4 P51582 6/20 0.54
LMNA P02545 1/20 0.48
THRB P10828 1/20 0.48
MTOR P42345 1/20 0.48
MDM2 Q00987 1/20 0.48
NCOA1 Q15788 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25631410 0.90 P2RY6 (0.57) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL18573984 0.88 P2RY6 (0.61) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL14929321 0.88 P2RY6 (0.61) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL14946392 0.88 P2RY6 (0.61) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL10594890 0.87 P2RY2 (0.54) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL453447 0.86 LMNA (0.65) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL453448 0.86 LMNA (0.65) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL20967857 0.86 LMNA (0.65) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL20628772 0.86 LMNA (0.65) P2RY6P2RY14NT5EP2RY2P2RY4
SCHEMBL14929347 0.86 LMNA (0.65) P2RY6P2RY14NT5EP2RY2P2RY4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0339075-B1 ACYLATED URIDINE AND CYTIDINE AND USES THEREOF PRO-NEURON, INC. (US) 1993-08-18 EP disclosed
EP-0339075-A1 ACYLATED URIDINE AND CYTIDINE AND USES THEREOF PRO-NEURON, INC. (US) 1989-11-02 EP disclosed